| SpectraBase Compound ID | 5M2uM1cZ4uF |
|---|---|
| InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i2D2 |
| InChIKey | KPOCSQCZXMATFR-CBTSVUPCSA-N |
| Mol Weight | 142.26 g/mol |
| Molecular Formula | C8H10D2S |
| Exact Mass | 142.078525 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 72rzzFB5N0h |
|---|---|
| Name | 3-(3,3-dideutero-n-butyl)thiophene |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H10D2S |
| InChI | InChI=1S/C8H12S/c1-2-3-4-8-5-6-9-7-8/h5-7H,2-4H2,1H3/i2D2 |
| InChIKey | KPOCSQCZXMATFR-CBTSVUPCSA-N |
| Molecular Weight | 142.256 g/mol |
| SMILES | c1sccc1CCC(C)([D])[D] |
| SPLASH | splash10-0002-9000000000-2eda2f17fe6ec44d46f7 |
| Source of Spectrum | O-29-432-0 |
| Wiley ID | 1139523 |